#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wxb s SER 2 N 0.00 -0.36 0.00 1.61 1.04 -1.26 -4.98 113.70 109.75 1wxb s SER 2 Ca 0.00 0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1wxb s SER 2 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1wxb s SER 2 CO 0.00 -0.31 0.00 -0.24 0.98 0.00 0.00 173.24 173.67 1wxb n SER 3 N 0.86 0.00 -4.16 7.02 2.88 -1.26 -4.60 113.62 114.36 1wxb n SER 3 Ca -0.10 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.06 1wxb n SER 3 Cb 0.58 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.99 1wxb n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wxb s GLY 4 N 0.00 3.10 -0.13 0.46 0.00 -1.26 -4.99 107.32 104.51 1wxb s GLY 4 Ca 0.00 -3.83 -0.05 0.00 0.00 0.00 0.00 44.72 40.84 1wxb s GLY 4 CO 0.00 1.23 0.27 -0.45 0.00 0.00 0.00 173.10 174.15 1wxb s SER 5 N 0.23 0.11 -0.21 1.64 0.15 -1.26 -4.98 113.70 109.38 1wxb s SER 5 Ca 0.28 0.60 -0.36 0.00 0.70 0.00 0.00 55.95 57.17 1wxb s SER 5 Cb -0.08 0.64 0.15 0.00 -1.71 0.00 0.00 66.02 65.02 1wxb s SER 5 CO -0.11 -0.22 1.32 -0.94 1.20 0.00 0.00 173.24 174.49 1wxb s SER 6 N 2.04 -0.06 0.00 5.45 1.04 -1.26 -5.07 113.70 115.83 1wxb s SER 6 Ca -0.03 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.39 1wxb s SER 6 Cb -0.11 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1wxb s SER 6 CO -0.09 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1wxb n GLY 7 N -0.14 2.20 3.88 7.32 0.00 -1.26 -5.16 105.19 112.03 1wxb n GLY 7 Ca 0.01 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1wxb n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wxb s LYS 8 N -1.61 3.27 0.07 1.61 2.36 -1.26 -4.99 119.74 119.19 1wxb s LYS 8 Ca 0.00 0.60 0.00 0.00 -2.55 0.00 0.00 55.97 54.02 1wxb s LYS 8 Cb 0.00 -2.07 -0.04 0.00 -1.05 0.00 0.00 37.83 34.68 1wxb s LYS 8 CO 0.00 -0.76 -0.05 0.71 1.55 0.00 0.00 175.35 176.80 1wxb s TYR 9 N -3.24 0.66 0.01 4.03 2.02 -1.26 -3.80 117.35 115.76 1wxb s TYR 9 Ca 0.56 -0.93 0.06 0.00 -0.37 0.00 0.00 57.07 56.40 1wxb s TYR 9 Cb -0.11 -0.43 -0.02 0.00 -0.40 0.00 0.00 41.96 41.01 1wxb s TYR 9 CO 0.53 -0.25 -0.20 0.54 -1.57 0.00 0.00 175.55 174.59 1wxb s VAL 10 N -3.44 1.57 -0.23 0.71 0.11 -1.10 -3.46 120.40 114.56 1wxb s VAL 10 Ca 0.06 -0.96 -0.06 0.00 -2.93 0.00 0.00 61.98 58.09 1wxb s VAL 10 Cb 0.04 -1.33 -0.03 0.00 -1.53 0.00 0.00 36.38 33.54 1wxb s VAL 10 CO -0.07 0.35 0.04 -0.75 -3.33 0.00 0.00 175.10 171.34 1wxb s LYS 11 N -0.72 3.62 -0.04 1.54 2.20 -1.12 -1.55 119.74 123.68 1wxb s LYS 11 Ca 0.07 -0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 54.88 1wxb s LYS 11 Cb -0.08 -3.21 -0.06 0.00 -1.51 0.00 0.00 37.83 32.97 1wxb s LYS 11 CO 0.00 -0.11 1.65 0.42 -0.36 0.00 0.00 175.35 176.95 1wxb s ILE 12 N 1.37 3.53 -0.13 5.43 -1.09 0.85 -2.96 121.20 128.20 1wxb s ILE 12 Ca 0.05 0.69 0.15 0.00 -2.23 0.00 0.00 60.65 59.32 1wxb s ILE 12 Cb -0.15 -3.45 -0.03 0.00 -1.58 0.00 0.00 42.46 37.26 1wxb s ILE 12 CO 0.02 -0.05 1.18 -0.07 -1.23 0.00 0.00 174.94 174.79 1wxb h LEU 13 N 10.00 0.00 -7.69 2.97 3.38 -1.20 -2.22 115.31 120.55 1wxb h LEU 13 Ca -0.40 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.40 1wxb h LEU 13 Cb 1.18 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.69 1wxb h LEU 13 CO 0.95 0.54 -0.56 -0.31 0.09 0.00 0.00 178.44 179.16 1wxb s TYR 14 N -2.94 -0.04 0.15 1.13 2.02 -1.26 -4.76 117.35 111.65 1wxb s TYR 14 Ca 0.01 0.09 -0.31 0.00 -0.37 0.00 0.00 57.07 56.49 1wxb s TYR 14 Cb 0.08 -0.01 -0.09 0.00 -0.40 0.00 0.00 41.96 41.54 1wxb s TYR 14 CO 0.78 -0.15 1.44 0.16 -1.57 0.00 0.00 175.55 176.21 1wxb s ASP 15 N -0.56 6.74 0.02 2.29 1.47 -1.26 -4.44 116.67 120.93 1wxb s ASP 15 Ca -0.06 2.45 0.06 0.00 1.18 0.00 0.00 52.55 56.17 1wxb s ASP 15 Cb -0.04 -2.59 -0.02 0.00 -0.34 0.00 0.00 42.92 39.93 1wxb s ASP 15 CO 0.01 -0.70 -0.17 0.12 0.68 0.00 0.00 175.17 175.10 1wxb s PHE 16 N 0.93 1.52 -0.26 2.11 5.36 0.12 -4.89 117.98 122.87 1wxb s PHE 16 Ca 0.65 -0.33 0.02 0.00 -0.96 0.00 0.00 56.93 56.31 1wxb s PHE 16 Cb -0.39 -0.93 0.05 0.00 -0.34 0.00 0.00 43.02 41.41 1wxb s PHE 16 CO 0.32 0.03 -0.10 0.99 -1.46 0.00 0.00 175.22 175.00 1wxb s THR 17 N -0.66 2.29 -0.49 0.12 2.01 -1.26 -1.04 115.64 116.61 1wxb s THR 17 Ca 0.05 -1.51 -0.45 0.00 0.31 0.00 0.00 61.69 60.09 1wxb s THR 17 Cb -0.08 -2.30 -0.19 0.00 0.01 0.00 0.00 72.50 69.94 1wxb s THR 17 CO 0.01 0.03 1.88 0.00 -0.69 0.00 0.00 174.62 175.85 1wxb n ALA 18 N 4.48 -0.50 0.16 7.40 0.00 -1.22 -4.77 120.51 126.06 1wxb n ALA 18 Ca -0.15 0.33 0.12 0.00 0.00 0.00 0.00 53.44 53.74 1wxb n ALA 18 Cb 0.43 -2.02 0.01 0.00 0.00 0.00 0.00 19.45 17.87 1wxb n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wxb n ARG 19 N 5.84 0.57 -3.02 0.00 5.12 -1.26 -4.94 116.66 118.97 1wxb n ARG 19 Ca 0.43 0.10 -0.12 0.00 -1.93 0.00 0.00 57.85 56.34 1wxb n ARG 19 Cb -0.04 -1.79 -0.03 0.00 -1.16 0.00 0.00 32.46 29.44 1wxb n ARG 19 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1wxb n ASN 20 N -2.58 1.81 0.05 0.55 3.02 -1.26 -5.05 115.26 111.79 1wxb n ASN 20 Ca 0.00 -1.88 -0.03 0.00 -0.03 0.00 0.00 54.58 52.64 1wxb n ASN 20 Cb 0.54 0.28 -0.08 0.00 -0.61 0.00 0.00 39.78 39.91 1wxb n ASN 20 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wxb h ALA 21 N 1.19 0.64 -0.69 5.41 0.00 -2.01 -3.31 119.26 120.48 1wxb h ALA 21 Ca -0.15 -0.92 -0.48 0.00 0.00 0.00 0.00 54.91 53.36 1wxb h ALA 21 Cb 0.50 0.18 -0.20 0.00 0.00 0.00 0.00 17.79 18.27 1wxb h ALA 21 CO 0.24 1.06 0.61 0.09 0.00 0.00 0.00 179.25 181.26 1wxb n ASN 22 N -3.07 6.98 -4.07 0.00 3.02 -1.26 -4.88 115.26 111.97 1wxb n ASN 22 Ca -0.07 -3.37 -0.08 0.00 -0.03 0.00 0.00 54.58 51.03 1wxb n ASN 22 Cb 0.88 -1.04 -0.10 0.00 -0.61 0.00 0.00 39.78 38.92 1wxb n ASN 22 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1wxb s GLU 23 N -2.64 0.69 0.14 3.52 2.02 -1.25 -2.34 118.70 118.84 1wxb s GLU 23 Ca 0.46 -1.22 0.09 0.00 0.02 0.00 0.00 54.97 54.31 1wxb s GLU 23 Cb 0.36 0.23 -0.04 0.00 0.10 0.00 0.00 34.13 34.78 1wxb s GLU 23 CO -0.03 -0.15 -0.14 -1.17 0.02 0.00 0.00 175.26 173.78 1wxb s LEU 24 N -2.93 2.84 -0.26 1.80 2.96 -1.19 -4.48 118.68 117.42 1wxb s LEU 24 Ca 0.09 -0.55 -0.06 0.00 -0.22 0.00 0.00 54.13 53.39 1wxb s LEU 24 Cb 0.08 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 45.14 1wxb s LEU 24 CO -0.08 0.15 0.04 -0.94 -1.32 0.00 0.00 176.35 174.20 1wxb s SER 25 N -2.42 4.89 0.23 3.68 1.04 -1.26 -3.36 113.70 116.50 1wxb s SER 25 Ca 0.21 -0.45 0.02 0.00 0.48 0.00 0.00 55.95 56.21 1wxb s SER 25 Cb -0.10 -1.85 -0.05 0.00 0.10 0.00 0.00 66.02 64.12 1wxb s SER 25 CO 0.12 -0.09 0.04 0.68 0.98 0.00 0.00 173.24 174.97 1wxb s VAL 26 N 1.53 0.75 0.53 5.02 -7.23 -0.21 -4.93 120.40 115.86 1wxb s VAL 26 Ca 0.05 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.23 1wxb s VAL 26 Cb -0.16 -2.40 0.01 0.00 0.56 0.00 0.00 36.38 34.39 1wxb s VAL 26 CO 0.01 -0.24 0.10 -0.76 -0.31 0.00 0.00 175.10 173.91 1wxb s LEU 27 N -3.27 2.34 0.26 1.32 1.43 -1.26 0.11 118.68 119.61 1wxb s LEU 27 Ca 0.31 -1.58 -0.29 0.00 -1.03 0.00 0.00 54.13 51.54 1wxb s LEU 27 Cb 0.07 -0.82 -0.09 0.00 0.03 0.00 0.00 46.19 45.37 1wxb s LEU 27 CO 0.09 -0.95 0.94 -0.75 0.23 0.00 0.00 176.35 175.91 1wxb s LYS 28 N -3.99 4.79 -0.27 1.70 2.20 -1.26 -3.40 119.74 119.50 1wxb s LYS 28 Ca 0.10 1.44 0.00 0.00 -0.36 0.00 0.00 55.97 57.16 1wxb s LYS 28 Cb 0.00 -3.17 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1wxb s LYS 28 CO 0.06 0.47 0.00 -3.47 -0.36 0.00 0.00 175.35 172.05 1wxb n ASP 29 N 1.27 -1.96 -4.75 1.43 2.03 -0.83 -4.93 116.55 108.81 1wxb n ASP 29 Ca -0.01 0.01 -0.22 0.00 0.52 0.00 0.00 54.79 55.08 1wxb n ASP 29 Cb 0.48 -1.15 -0.06 0.00 -0.72 0.00 0.00 41.12 39.67 1wxb n ASP 29 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1wxb s GLU 30 N -3.89 2.55 -0.06 -0.67 2.02 -1.22 -4.93 118.70 112.50 1wxb s GLU 30 Ca 0.00 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.65 1wxb s GLU 30 Cb 0.00 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.93 1wxb s GLU 30 CO 0.00 0.26 -0.04 0.08 0.02 0.00 0.00 175.26 175.59 1wxb s VAL 31 N -2.30 0.56 0.53 2.63 1.01 -1.26 -0.10 120.40 121.46 1wxb s VAL 31 Ca 0.35 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.28 1wxb s VAL 31 Cb -0.06 -0.62 0.01 0.00 0.00 0.00 0.00 36.38 35.72 1wxb s VAL 31 CO 0.23 0.25 0.18 -0.76 0.00 0.00 0.00 175.10 175.01 1wxb s LEU 32 N 1.30 2.48 -0.42 3.92 2.01 -0.59 -4.90 118.68 122.47 1wxb s LEU 32 Ca -0.05 -1.47 -0.07 0.00 0.01 0.00 0.00 54.13 52.55 1wxb s LEU 32 Cb -0.14 -0.94 0.10 0.00 0.01 0.00 0.00 46.19 45.22 1wxb s LEU 32 CO -0.02 -0.97 0.24 -0.70 1.01 0.00 0.00 176.35 175.91 1wxb s GLU 33 N -4.06 2.37 -0.00 1.70 2.12 -1.11 -2.70 118.70 117.01 1wxb s GLU 33 Ca 0.18 -1.63 -0.30 0.00 0.36 0.00 0.00 54.97 53.58 1wxb s GLU 33 Cb -0.00 -3.70 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 1wxb s GLU 33 CO 0.11 -1.02 1.38 0.54 -0.54 0.00 0.00 175.26 175.73 1wxb s VAL 34 N 1.30 3.77 -0.16 3.70 0.11 -1.25 -2.01 120.40 125.86 1wxb s VAL 34 Ca 0.05 1.15 -0.02 0.00 -2.93 0.00 0.00 61.98 60.23 1wxb s VAL 34 Cb -0.23 -3.74 -0.09 0.00 -1.53 0.00 0.00 36.38 30.78 1wxb s VAL 34 CO -0.01 0.00 -0.16 0.18 -3.33 0.00 0.00 175.10 171.78 1wxb n LEU 35 N 5.30 2.45 -4.23 2.54 4.77 -0.70 -4.70 117.00 122.43 1wxb n LEU 35 Ca 0.13 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.78 1wxb n LEU 35 Cb 0.44 -0.53 -0.16 0.00 -2.33 0.00 0.00 43.42 40.84 1wxb n LEU 35 CO 0.58 0.64 -0.52 -1.61 -1.33 0.00 0.00 177.39 175.15 1wxb s GLU 36 N -2.31 3.12 0.29 3.23 2.02 -1.23 -5.01 118.70 118.81 1wxb s GLU 36 Ca -0.22 -0.82 0.03 0.00 0.02 0.00 0.00 54.97 53.99 1wxb s GLU 36 Cb 0.06 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 1wxb s GLU 36 CO 0.34 0.08 0.19 0.16 0.02 0.00 0.00 175.26 176.04 1wxb s ASP 37 N 0.62 1.27 0.00 -0.19 -4.77 -1.26 -2.51 116.67 109.83 1wxb s ASP 37 Ca -0.11 -1.58 0.00 0.00 -3.30 0.00 0.00 52.55 47.57 1wxb s ASP 37 Cb -0.16 0.43 0.00 0.00 -1.09 0.00 0.00 42.92 42.10 1wxb s ASP 37 CO 0.03 -0.93 0.00 0.61 0.70 0.00 0.00 175.17 175.58 1wxb n GLY 38 N -0.53 1.26 3.77 2.12 0.00 -1.26 -5.04 105.19 105.51 1wxb n GLY 38 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1wxb n GLY 38 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wxb s ARG 39 N -0.78 2.63 0.06 1.61 6.06 -1.26 -5.04 118.95 122.23 1wxb s ARG 39 Ca 0.00 -1.28 -0.13 0.00 -2.50 0.00 0.00 55.73 51.82 1wxb s ARG 39 Cb 0.00 -2.38 -0.04 0.00 0.06 0.00 0.00 34.95 32.60 1wxb s ARG 39 CO 0.00 0.29 1.22 0.37 -2.50 0.00 0.00 175.30 174.68 1wxb h GLN 40 N 1.56 -0.09 -5.62 5.12 4.15 -1.97 -3.38 115.11 114.88 1wxb h GLN 40 Ca -0.46 0.01 -0.61 0.00 0.77 0.00 0.00 58.65 58.36 1wxb h GLN 40 Cb 1.25 0.02 -0.09 0.00 0.21 0.00 0.00 27.48 28.87 1wxb h GLN 40 CO 0.61 -0.06 -0.33 -1.58 -1.93 0.00 0.00 178.83 175.53 1wxb s TRP 41 N -4.06 3.54 0.43 3.99 0.52 -1.26 -3.77 118.94 118.32 1wxb s TRP 41 Ca -0.05 0.66 0.01 0.00 0.02 0.00 0.00 56.10 56.74 1wxb s TRP 41 Cb 0.04 -2.26 -0.00 0.00 -1.15 0.00 0.00 33.47 30.10 1wxb s TRP 41 CO 0.25 0.41 0.63 -1.58 0.02 0.00 0.00 176.95 176.69 1wxb s TRP 42 N -0.11 3.21 -0.38 -1.98 0.51 -1.00 -4.86 118.94 114.33 1wxb s TRP 42 Ca 0.17 0.15 0.00 0.00 -2.12 0.00 0.00 56.10 54.31 1wxb s TRP 42 Cb -0.13 -2.25 0.11 0.00 -0.81 0.00 0.00 33.47 30.39 1wxb s TRP 42 CO 0.06 -0.28 0.14 0.21 -0.51 0.00 0.00 176.95 176.56 1wxb s LYS 43 N -4.48 1.77 0.47 4.98 2.20 -1.04 -2.36 119.74 121.27 1wxb s LYS 43 Ca 0.47 -1.87 0.02 0.00 -0.36 0.00 0.00 55.97 54.24 1wxb s LYS 43 Cb -0.10 -3.41 0.01 0.00 -1.51 0.00 0.00 37.83 32.82 1wxb s LYS 43 CO 0.37 -1.01 0.67 -0.51 -0.36 0.00 0.00 175.35 174.51 1wxb s LEU 44 N 0.99 3.55 -0.15 5.43 2.01 -1.06 -1.72 118.68 127.73 1wxb s LEU 44 Ca 0.10 0.04 -0.04 0.00 0.01 0.00 0.00 54.13 54.24 1wxb s LEU 44 Cb -0.21 -2.95 0.07 0.00 0.01 0.00 0.00 46.19 43.11 1wxb s LEU 44 CO -0.06 -0.84 0.19 -0.60 1.01 0.00 0.00 176.35 176.06 1wxb s ARG 45 N -4.56 0.12 0.75 1.70 3.52 -0.85 -2.50 118.95 117.12 1wxb s ARG 45 Ca 0.52 0.36 -0.11 0.00 -0.13 0.00 0.00 55.73 56.37 1wxb s ARG 45 Cb -0.10 -0.81 0.04 0.00 -1.56 0.00 0.00 34.95 32.51 1wxb s ARG 45 CO 0.37 -0.50 1.08 0.45 -0.81 0.00 0.00 175.30 175.89 1wxb s SER 46 N 2.31 4.85 0.56 -2.12 0.15 -0.50 -2.77 113.70 116.18 1wxb s SER 46 Ca 0.05 1.69 0.34 0.00 0.70 0.00 0.00 55.95 58.72 1wxb s SER 46 Cb -0.14 -2.47 1.86 0.00 -1.71 0.00 0.00 66.02 63.56 1wxb s SER 46 CO -0.09 -1.80 2.04 0.03 1.20 0.00 0.00 173.24 174.62 1wxb h ARG 47 N -0.96 0.00 0.00 5.44 -0.00 -1.90 0.31 114.38 117.27 1wxb h ARG 47 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.04 1wxb h ARG 47 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.20 1wxb h ARG 47 CO 0.54 0.00 0.00 0.43 0.00 0.00 0.00 179.97 180.94 1wxb n SER 48 N -2.76 0.00 0.00 7.04 7.64 -1.26 -4.82 113.62 119.46 1wxb n SER 48 Ca -0.02 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.05 1wxb n SER 48 Cb 0.13 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1wxb n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wxb n GLY 49 N 0.03 2.62 3.74 0.23 0.00 0.11 -5.03 105.19 106.89 1wxb n GLY 49 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1wxb n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wxb s GLN 50 N -0.59 2.55 -0.09 1.61 1.11 -1.24 -4.80 119.66 118.19 1wxb s GLN 50 Ca 0.00 1.69 -0.04 0.00 0.01 0.00 0.00 55.36 57.02 1wxb s GLN 50 Cb 0.00 -1.89 0.05 0.00 -1.01 0.00 0.00 33.01 30.16 1wxb s GLN 50 CO 0.00 -1.51 0.22 0.00 0.01 0.00 0.00 175.29 174.01 1wxb s ALA 51 N -1.95 -0.47 0.19 6.09 0.00 -1.26 -1.40 121.76 122.95 1wxb s ALA 51 Ca 0.73 0.90 -0.12 0.00 0.00 0.00 0.00 51.96 53.48 1wxb s ALA 51 Cb -0.27 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.24 1wxb s ALA 51 CO 0.41 -0.22 0.38 0.20 0.00 0.00 0.00 175.76 176.53 1wxb s GLY 52 N 1.32 0.35 0.13 0.00 0.00 -1.04 -4.80 107.32 103.28 1wxb s GLY 52 Ca -0.09 -0.73 -0.08 0.00 0.00 0.00 0.00 44.72 43.83 1wxb s GLY 52 CO -0.08 -0.66 0.42 -0.19 0.00 0.00 0.00 173.10 172.59 1wxb s TYR 53 N -3.95 3.52 0.18 1.90 2.02 -0.99 -2.56 117.35 117.47 1wxb s TYR 53 Ca 0.16 0.73 -0.10 0.00 -0.37 0.00 0.00 57.07 57.49 1wxb s TYR 53 Cb 0.02 -2.13 -0.01 0.00 -0.40 0.00 0.00 41.96 39.44 1wxb s TYR 53 CO 0.01 0.44 0.33 0.14 -1.57 0.00 0.00 175.55 174.90 1wxb s VAL 54 N -1.57 0.05 0.34 0.71 -7.23 -0.99 -3.14 120.40 108.57 1wxb s VAL 54 Ca 0.39 -1.39 -0.27 0.00 -1.81 0.00 0.00 61.98 58.90 1wxb s VAL 54 Cb -0.13 -1.93 -0.09 0.00 0.56 0.00 0.00 36.38 34.79 1wxb s VAL 54 CO 0.21 -0.21 1.07 -2.16 -0.31 0.00 0.00 175.10 173.69 1wxb s PRO 55 N -3.98 4.39 0.00 4.82 0.04 -1.26 -2.36 135.00 136.64 1wxb s PRO 55 Ca 0.19 1.64 0.30 0.00 0.04 0.00 0.00 61.00 63.17 1wxb s PRO 55 Cb 0.03 -2.84 1.72 0.00 0.04 0.00 0.00 34.50 33.44 1wxb s PRO 55 CO 0.02 0.03 2.12 0.00 0.04 0.00 0.00 177.00 179.21 1wxb h ASN 57 N 0.00 0.42 0.73 0.00 4.21 -1.91 -2.86 115.58 116.18 1wxb h ASN 57 Ca 0.00 -0.20 0.00 0.00 1.21 0.00 0.00 56.30 57.31 1wxb h ASN 57 Cb 0.10 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.18 1wxb h ASN 57 CO 0.00 0.83 -1.20 2.30 -1.29 0.00 0.00 177.43 178.07 1wxb n ILE 58 N -3.99 0.44 -1.92 2.81 -5.35 -1.16 -4.91 119.36 105.27 1wxb n ILE 58 Ca -0.02 -0.50 -0.33 0.00 -0.27 0.00 0.00 62.75 61.63 1wxb n ILE 58 Cb 0.53 -0.21 0.03 0.00 -1.74 0.00 0.00 39.64 38.25 1wxb n ILE 58 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1wxb s LEU 59 N -5.01 3.47 -0.10 7.28 1.43 -1.08 -0.66 118.68 124.02 1wxb s LEU 59 Ca -0.01 1.95 -0.07 0.00 -1.03 0.00 0.00 54.13 54.97 1wxb s LEU 59 Cb 0.11 -4.55 0.04 0.00 0.03 0.00 0.00 46.19 41.82 1wxb s LEU 59 CO 0.81 -1.41 0.25 -0.83 0.23 0.00 0.00 176.35 175.41 1wxb s GLY 60 N -2.56 -0.17 -0.26 -3.19 0.00 -1.15 -4.83 107.32 95.16 1wxb s GLY 60 Ca 0.66 0.91 -0.28 0.00 0.00 0.00 0.00 44.72 46.02 1wxb s GLY 60 CO 0.38 1.03 2.21 -0.54 0.00 0.00 0.00 173.10 176.18 1wxb s GLU 61 N 0.85 3.02 -0.30 2.90 2.02 -1.26 -2.78 118.70 123.15 1wxb s GLU 61 Ca -0.06 1.90 -0.13 0.00 0.02 0.00 0.00 54.97 56.70 1wxb s GLU 61 Cb -0.07 -4.39 -0.03 0.00 0.10 0.00 0.00 34.13 29.74 1wxb s GLU 61 CO -0.05 -2.23 0.28 0.00 0.02 0.00 0.00 175.26 173.27 1wxb s ALA 62 N 8.67 3.53 0.85 5.21 0.00 -1.22 -4.94 121.76 133.85 1wxb s ALA 62 Ca 0.98 -1.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.69 1wxb s ALA 62 Cb -0.30 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.17 1wxb s ALA 62 CO 0.34 -0.77 0.41 -1.13 0.00 0.00 0.00 175.76 174.61 1wxb n SER 63 N 5.20 -1.86 -4.97 0.00 3.41 -1.26 -4.50 113.62 109.65 1wxb n SER 63 Ca -0.11 0.44 -0.21 0.00 -0.26 0.00 0.00 58.87 58.73 1wxb n SER 63 Cb 0.51 -1.19 -0.02 0.00 -0.26 0.00 0.00 64.21 63.25 1wxb n SER 63 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1wxb s GLY 64 N -1.72 1.23 0.61 5.00 0.00 -1.26 -4.87 107.32 106.31 1wxb s GLY 64 Ca 0.60 -1.20 -0.15 0.00 0.00 0.00 0.00 44.72 43.97 1wxb s GLY 64 CO 0.64 -1.21 1.05 2.56 0.00 0.00 0.00 173.10 176.14 1wxb s PRO 65 N -4.02 3.29 -0.32 2.90 0.04 -1.26 -5.04 135.00 130.59 1wxb s PRO 65 Ca 0.35 1.12 -0.10 0.00 0.04 0.00 0.00 61.00 62.40 1wxb s PRO 65 Cb -0.09 -2.03 0.19 0.00 0.04 0.00 0.00 34.50 32.61 1wxb s PRO 65 CO 0.30 -0.83 1.09 -1.12 0.04 0.00 0.00 177.00 176.48 1wxb s SER 66 N -3.07 -0.22 -0.24 6.66 0.01 -1.26 -5.14 113.70 110.44 1wxb s SER 66 Ca 0.62 -0.15 -0.03 0.00 1.31 0.00 0.00 55.95 57.70 1wxb s SER 66 Cb -0.15 0.29 0.13 0.00 0.21 0.00 0.00 66.02 66.49 1wxb s SER 66 CO 0.41 -0.02 0.34 -0.55 0.41 0.00 0.00 173.24 173.83 1wxb s SER 67 N 1.74 0.56 0.00 2.44 0.15 -1.26 -5.34 113.70 111.99 1wxb s SER 67 Ca 0.16 0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.85 1wxb s SER 67 Cb 0.06 0.93 0.00 0.00 -1.71 0.00 0.00 66.02 65.31 1wxb s SER 67 CO -0.14 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.59